Vitas-M small molecule compound

2-(3,5-dimethylpiperidin-1-yl)-9-methyl-3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK815893
SMILES CCCCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CC(C)CC(C2)C)/C1=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C28H38N4O2S2 MW 526.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H38N4O2S2/c1-5-6-7-8-9-10-13-32-27(34)23(36-28(32)35)16-22-25(30-17-19(2)15-20(3)18-30)29-24-21(4)12-11-14-31(24)26(22)33/h11-12,14,16,19-20H,5-10,13,15,17-18H2,1-4H3/b23-16-
InChIKey
AGZMBLCJMMGRBP-KQWNVCNZSA-N
Synonyms

(5Z)5((2(35DIMETHYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)5((2(35dimethylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3octyl2thioxothiazolidin4one
2(35dimethylpiperidin1yl)9methyl3((Z)(3octyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CC(CC(C4)C)C)SC1=S
CCCCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CC(C)CC(C2)C)C1=O
InChI=1SC28H38N4O2S2c15678910133227(34)23(3628(32)35)162225(301719(2)1520(3)1830)292421(4)12111431(24)26(22)33h111214161920H51013151718H214H3b2316
MFCD04567882
ZINC000097946539
ZINC000097946541

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Available files

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